input word = C00057583

Metabolite InformationStructural formula
Name Nigramide D
Formula C36H40N2O6
Mw 596.28863702
CAS RN 847552-85-6
C_ID C00057583
InChIKey GCQHTQHVLFJWAH-ILPOJUMXSA-N
InChICode InChI=1S/C36H40N2O6/c39-35(37-17-5-1-6-18-37)29-14-13-27(26-12-16-31-33(22-26)44-24-42-31)28(34(29)36(40)38-19-7-2-8-20-38)10-4-3-9-25-11-15-30-32(21-25)43-23-41-30/h3-4,9-16,21-22,27-29,34H,1-2,5-8,17-20,23-24H2/b9-3+,10-4+/t27-,28+,29-,34-/m0/s1
SMILES O=C([C@H]1[C@H](/C=C/C=C/c2ccc3c(c2)OCO3)[C@H](c2ccc3c(c2)OCO3)C=C[C@@H]1C(=O)N1CCCCC1)N1CCCCC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePiperaceaePiper nigrum Ref.
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